| SpectraBase Compound ID | 7KnFigJUYjb |
|---|---|
| InChI | InChI=1S/C13H20O4/c1-8(14)9-4-13(16)10(2)5-12(9,15)6-11(13,3)17-7-10/h9,15-16H,4-7H2,1-3H3/t9?,10-,11-,12-,13+/m0/s1 |
| InChIKey | LDUXISPHWOIQAZ-LGNXWEDYSA-N |
| Mol Weight | 240.3 g/mol |
| Molecular Formula | C13H20O4 |
| Exact Mass | 240.136159 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7uiGBMewbOj |
|---|---|
| Name | drummondone b |
| CAS Registry Number | 100760-76-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H20O4 |
| InChI | InChI=1S/C13H20O4/c1-8(14)9-4-13(16)10(2)5-12(9,15)6-11(13,3)17-7-10/h9,15-16H,4-7H2,1-3H3/t9?,10-,11-,12-,13+/m0/s1 |
| InChIKey | LDUXISPHWOIQAZ-LGNXWEDYSA-N |
| Molecular Weight | 240.299 g/mol |
| SMILES | O[C@@]12C[C@@]3([C@](CC2C(=O)C)([C@](C1)(OC3)C)O)C |
| SPLASH | splash10-059f-9400000000-77c6e013cd549a820943 |
| Source of Spectrum | J-51-1076-6 |
| Wiley ID | 1242865 |